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211245-63-5 | 5-Pyrimidinemethanol, 4-(cyclopentylamino)-2-(methylthio)-
CAS No: 211245-63-5 Catalog No: AG002L8Z MDL No:MFCD09833995
Product Description
Catalog Number:
AG002L8Z
Chemical Name:
5-Pyrimidinemethanol, 4-(cyclopentylamino)-2-(methylthio)-
CAS Number:
211245-63-5
Molecular Formula:
C11H17N3OS
Molecular Weight:
239.3372
MDL Number:
MFCD09833995
IUPAC Name:
[4-(cyclopentylamino)-2-methylsulfanylpyrimidin-5-yl]methanol
InChI:
InChI=1S/C11H17N3OS/c1-16-11-12-6-8(7-15)10(14-11)13-9-4-2-3-5-9/h6,9,15H,2-5,7H2,1H3,(H,12,13,14)
InChI Key:
HKGVZNNJDXEJQC-UHFFFAOYSA-N
SMILES:
OCc1cnc(nc1NC1CCCC1)SC
Properties
Complexity:
211
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.109g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
239.337g/mol
Monoisotopic Mass:
239.109g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
83.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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